Compound Identification
SMILES
CC1([C@@H]2CCC(O2)C1C(O)=O)C(O)=O
InChIKey
InChIKey=XIUCRMDWTGSKBJ-OEIIGTGJSA-N
Formula
C9H12O5
Mass
200.19
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Lipids and lipid-like molecules
-
Class
Fatty Acyls
-
Subclass
Fatty acids and conjugates
- Level 5 Heterocyclic fatty acids
-
Subclass
Fatty acids and conjugates
-
Class
Fatty Acyls
-
Superclass
Lipids and lipid-like molecules
Kingdom
Organic compounds
Superclass
Lipids and lipid-like molecules
Class
Fatty Acyls
Subclass
Fatty acids and conjugates
Intermediate Tree Nodes
Not available
Direct Parent
Heterocyclic fatty acids
Alternative Parents
Methyl-branched fatty acids Dicarboxylic acids and derivatives Tetrahydrofurans Oxacyclic compounds Dialkyl ethers Carboxylic acids Organic oxides Hydrocarbon derivatives
Molecular Framework
Aliphatic heteropolycyclic compounds
Substituents
Methyl-branched fatty acid - Heterocyclic fatty acid - Branched fatty acid - Dicarboxylic acid or derivatives - Tetrahydrofuran - Oxacycle - Organoheterocyclic compound - Ether - Dialkyl ether - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as heterocyclic fatty acids. These are fatty acids containing a heterocyclic attached to the acyl chain.
External Descriptors
Not available